Match comparison for Hartree energy (match type 23860)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
6.510589381000000e+01 | 3.000000000000000e-06 | 6.510589346066666e+01 | 8.731587638959062e-07 | 6.510589361500000e+01 | 1.315000005774891e-06 | PASS |
Checks for this match
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Detailed information
Reference: 65.10589381, precision: 0.000003Run | Value | Difference | Relative difference | Status |
foss_cmake: [foss2022a-serial, foss-min] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
foss_min_autotools: [foss2022a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
foss_cmake: [foss2022a-serial, foss-full] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
foss_min_autotools: [foss2023a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
foss_min_autotools: [foss2023b-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
foss_autotools: [foss2022a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
foss_autotools: [foss2023a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
foss_opt_autotools: [foss2023a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
intel_autotools: [intel2023a-serial] | 6.510589466000000e+01 | 8.500000063804691e-07 | 2.833333354601564e-01 | PASS |
foss_cmake: [foss2022a-mpi, foss-min-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
foss_cmake: [foss2023a-mpi, foss-min-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
foss_mpi_min_autotools: [foss2023a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
foss_cmake: [foss2022a-mpi, foss-full-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
foss_mpi_min_autotools: [foss2022a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
foss_cmake: [foss2023a-mpi, foss-full-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
foss_autotools: [foss2023b-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
foss_omp_autotools: [foss2023a-serial] | 6.510589401999999e+01 | 2.099999960591958e-07 | 6.999999868639861e-02 | PASS |
foss_mpi_opt_autotools: [foss2023a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
foss_mpi_autotools: [foss2022a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
foss_mpi_autotools: [foss2023a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
intel_omp_autotools: [intel2022a-serial] | 6.510589444999999e+01 | 6.399999961104186e-07 | 2.133333320368062e-01 | PASS |
intel_omp_autotools: [intel2023a-serial] | 6.510589385999999e+01 | 4.999999703159119e-08 | 1.666666567719706e-02 | PASS |
foss_ppc_autotools: [foss2022a-serial] | 6.510589493000001e+01 | 1.120000007404087e-06 | 3.733333358013624e-01 | PASS |
foss_debug_autotools: [foss2023a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 3.666666733200449e-02 | PASS |
foss_cuda_autotools: [foss2022a-cuda-mpi] | 6.510589395000000e+01 | 1.399999973727972e-07 | 4.666666579093241e-02 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | 6.510589432000000e+01 | 5.100000066704524e-07 | 1.700000022234841e-01 | PASS |
foss_mpi_debug_autotools: [foss2023a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -5.033333347152317e-01 | PASS |
foss_mpi_omp_autotools: [foss2023a-mpi] | 6.510589449000000e+01 | 6.799999994200334e-07 | 2.266666664733445e-01 | PASS |
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 6.510589379000000e+01 | -2.000000165480742e-08 | -6.666667218269140e-03 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | 6.510589315000000e+01 | -6.599999977652260e-07 | -2.199999992550753e-01 | PASS |